[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl] 6-methoxy-2-methyl-quinoline-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl] 6-methoxy-2-methyl-quinoline-3-carboxylate Openeye Name: [2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl] 6-methoxy-2-methyl-quinoline-3-carboxylate CAS Name: 6-methoxy-2-methyl-3-quinolinecarboxylic acid [1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl] ester IUPAC Name: [1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl] 6-methoxy-2-methylquinoline-3-carboxylate Traditional Name: 6-methoxy-2-methyl-quinoline-3-carboxylic acid [2-(4-benzylpiperazino)-2-keto-1-methyl-ethyl] ester Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)OC(C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)OC(C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4/c1-18-23(16-21-15-22(32-3)9-10-24(21)27-18)26(31)33-19(2)25(30)29-13-11-28(12-14-29)17-20-7-5-4-6-8-20/h4-10,15-16,19H,11-14,17H2,1-3H3